4DDX
Thermotoga maritima reverse gyrase, primitive monoclinic form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-10-15 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 125.815, 104.896, 126.181 |
| Unit cell angles | 90.00, 91.72, 90.00 |
Refinement procedure
| Resolution | 48.428 - 4.170 |
| R-factor | 0.2476 |
| Rwork | 0.244 |
| R-free | 0.30490 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ddt |
| RMSD bond length | 0.003 |
| RMSD bond angle | 2.351 |
| Data reduction software | XDS ((VERSION December 6) |
| Data scaling software | SADABS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: dev_881)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.200 | 4.270 |
| High resolution limit [Å] | 4.170 | 4.170 |
| Rmerge | 0.284 | 0.631 |
| Number of reflections | 24000 | |
| <I/σ(I)> | 3.12 | 1.21 |
| Completeness [%] | 96.8 | 97.7 |
| Redundancy | 2.94 | 2.86 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.8 | 295 | 20mM citric acid, 80mM Bis-Tris propane pH 8.8, 16% PEG3350, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
